Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | BRUKER AXS MICROSTAR-H |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 2011-01-03 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 53.560, 71.350, 61.510 |
| Unit cell angles | 90.00, 114.33, 90.00 |
Refinement procedure
| Resolution | 56.080 - 1.810 |
| R-factor | 0.18464 |
| Rwork | 0.183 |
| R-free | 0.21855 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4agk |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.434 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.070 | 1.890 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.060 | 0.510 |
| Number of reflections | 38673 | |
| <I/σ(I)> | 15.1 | 3 |
| Completeness [%] | 97.6 | 83.6 |
| Redundancy | 3.8 | 3.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 0.2 M SODIUM CITRATE TRIBASIC DIHYDRATE & 20% W/V POLYETHYLENE GLYCOL 3,350 |
